Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.46 |
| ▸ | LIG1 | P18858 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7764770 | 0.90 | HPGD (0.55) | HPGDTSHRMAPK1HSD17B10LIG1 | |
| 1-Allyloxy-2-Methoxybenzene SCHEMBL30083991 | 0.86 | CA12 (0.54) | HPGDTSHRMAPK1HSD17B10LIG1 | |
| 1-Allyloxy-2-Methoxybenzene SCHEMBL73345 | 0.86 | CA12 (0.54) | HPGDTSHRMAPK1HSD17B10LIG1 | |
| SCHEMBL6665177 | 0.82 | SYK (0.56) | HPGDTSHRMAPK1HSD17B10SHMT2 | |
| SCHEMBL28538424 | 0.80 | MAPT (0.50) | HPGDTSHRMAPK1HSD17B10LIG1 | |
| SCHEMBL8637600 | 0.80 | LIG1 (0.47) | HPGDTSHRMAPK1HSD17B10LIG1 | |
| SCHEMBL28547491 | 0.80 | HPGD (0.46) | HPGDTSHRMAPK1HSD17B10LIG1 | |
| 1,2-Diallyloxybenzene SCHEMBL29768784 | 0.80 | HPGD (0.60) | HPGDTSHRMAPK1HSD17B10LIG1 | |
| 1,2-Diallyloxybenzene SCHEMBL366516 | 0.80 | HPGD (0.60) | HPGDTSHRMAPK1HSD17B10LIG1 | |
| SCHEMBL515196 | 0.79 | ADRB2 (0.59) | HTR7HPGDTSHRMAPK1HSD17B10 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004024684-A2 | ENANTIOSELECTIVE AMINATION AND ETHERIFICATION | YALE UNIVERSITY (US) | 2004-03-25 | — | — | WO | disclosed |